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Compound InformationSONAR Target prediction
Name:

GENISTEIN, 8-METHYL

Unique Identifier:SPE00201355
MolClass: Checkout models in ver1.5 and ver1.0
Molecular Formula:C16H12O5
Molecular Weight:272.168 g/mol
X log p:12.714  (online calculus)
Lipinksi Failures1
TPSA26.3
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptors Count:5
Rotatable Bond Count:1
Canonical Smiles:Cc1c(O)cc(O)c2C(=O)C(=COc12)c1ccc(O)cc1

Found: 101 nonactive as graph: single | with analogs [1] << Back 51 52 53 54 55 56 57 58 59 60  Next >> [101]
Species: 4896
Condition: MT1181-W303mata
Replicates: 2
Raw OD Value: r im 0.4626±0.0142128
Normalized OD Score: sc h 0.9894±0.0307499
Z-Score: -0.1095±0.313829
p-Value: 0.825416
Z-Factor: -7.36254
Fitness Defect: 0.1919
Bioactivity Statement: Nonactive
Experimental Conditions
Library:Spectrum
Plate Number and Position:5|B11
Drug Concentration:50.00 nM
OD Absorbance:600 nm
Robot Temperature:27.10 Celcius
Date:2005-12-14 YYYY-MM-DD
Plate CH Control (+):0.48224999999999996±0.01984
Plate DMSO Control (-):0.4232±0.04034
Plate Z-Factor:-5.8734
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DBLink | Rows returned: 1
5781195 5,7-dihydroxy-3-(4-hydroxyphenyl)-8-methyl-chromen-4-one

internal high similarity DBLink | Rows returned: 92 Next >> 
LOPAC 00426 0.9070
SPE00200789 0.9070
SPE01500726 0.9084
SPE10100004 0.9084
SPE00240565 0.9147
SPE10100003 0.9154

active | Cluster 7497 | Additional Members: 7 | Rows returned: 5
SPE00201584 0.527472527472527
SPE00300348 0.476190476190476
SPE00201581 0.463414634146341
SPE00201580 0.180555555555556
SPE00201595 0

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